acetic acid;acetic acid;alumane;zinc

C4H10AlO4Zn- — CID 174731596

IUPACacetic acid;acetic acid;alumane;zinc
SMILESCC(=O)O.[AlH3].[CH2-]C(=O)O.[Zn]
InChIInChI=1S/C2H4O2.C2H3O2.Al.Zn.3H/c2*1-2(3)4;;;;;/h1H3,(H,3,4);1H2,(H,3,4);;;;;/q;-1;;;;;
InChIKeyRAFPKXCLKBMBOB-UHFFFAOYSA-N
MW214.49 g/mol
LogP-1.19
Rot. Bonds

About acetic acid;acetic acid;alumane;zinc

acetic acid;acetic acid;alumane;zinc (PubChem CID 174731596) has the molecular formula C4H10AlO4Zn- and a molecular weight of 214.49 g/mol. Its IUPAC name is acetic acid;acetic acid;alumane;zinc.

Molecular Properties

Compound Nameacetic acid;acetic acid;alumane;zinc
PubChem CID174731596
Molecular FormulaC4H10AlO4Zn-
Molecular Weight214.49 g/mol
Exact Mass212.97
IUPAC Nameacetic acid;acetic acid;alumane;zinc
SMILESCC(=O)O.[AlH3].[CH2-]C(=O)O.[Zn]
InChIInChI=1S/C2H4O2.C2H3O2.Al.Zn.3H/c2*1-2(3)4;;;;;/h1H3,(H,3,4);1H2,(H,3,4);;;;;/q;-1;;;;;
InChIKeyRAFPKXCLKBMBOB-UHFFFAOYSA-N
XLogP-1.19
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.49
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 175305770
acetic acid
CID 158444727
acetic acid;alumane;cobalt;nickel
CID 175191172
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CID 174107253
acetic acid;platinum
CID 154096540
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CID 173443465

Frequently Asked Questions

What is the IUPAC name of acetic acid;acetic acid;alumane;zinc?
The IUPAC name of acetic acid;acetic acid;alumane;zinc (CID 174731596) is acetic acid;acetic acid;alumane;zinc.
What is the SMILES notation for acetic acid;acetic acid;alumane;zinc?
The canonical SMILES for acetic acid;acetic acid;alumane;zinc is CC(=O)O.[AlH3].[CH2-]C(=O)O.[Zn].
What is the InChIKey of acetic acid;acetic acid;alumane;zinc?
The InChIKey is RAFPKXCLKBMBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.C2H3O2.Al.Zn.3H/c2*1-2(3)4;;;;;/h1H3,(H,3,4);1H2,(H,3,4);;;;;/q;-1;;;;;.
What are the key properties of acetic acid;acetic acid;alumane;zinc?
acetic acid;acetic acid;alumane;zinc has a molecular weight of 214.49 g/mol, XLogP of -1.19, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;acetic acid;alumane;zinc is sourced from PubChem (CID 174731596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).